Dataset

0_REAL_LIME_COUMARIN_NMR_LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL.tocsy

Chemical Info

InChI	InChI=1S/C20H24O4/c1-14(2)6-5-7-15(3)10-11-23-18-13-17(22-4)12-16-8-9-19(21)24-20(16)18/h6,8-10,12-13H,5,7,11H2,1-4H3/b15-10+
SMILES	COC1=CC(OC/C=C(\C)CCC=C(C)C)=C2OC(=O)C=CC2=C1
InChI Key	RYLVZXZNMTZICA-XNTDXEJSSA-N

Data and Resources

• 0_REAL_LIME_COUMARIN_NMR_LIME_COUMARIN_THIX-029...HTML
  Explore

  • More information
  • Go to resource

• total-correlation-s...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.57992/nmrxiv.p78.s678.d3391
License URL	https://creativecommons.org/licenses/by-nc-sa/4.0/legalcode
Source	https://nmrxiv.org/D3391
Version
Author
Maintainer
Language	english
MetadataCreated	2025-02-03T16:28:06.128998
MetadataModified	2025-02-03T16:28:06.129005
MetadataPublished	2024-08-02 19:43:39
Related Molecule

Field	Value
Measurement Technique	total correlation spectroscopy
Measurement Variables	NMR solvent : CDCl3 acquisition nucleus : 1H , 1H NMR spectrum by dimensionality : 2 NMR probe : Z125869_0046 (CPP BBO 500S1 BB-H&F-D-05 Z) Temperature : 298.1495 K irradiation frequency : 500.13 MHz , 500.13 MHz magnetic field strength : 11.746350827011339 Tesla number of scans : 10 scans nuclear magnetic resonance pulse sequence : mlevphpr.2 Spectral Width : 9.99735368826195 , 9.99735368826195 number of data points : 5 points relaxation time measurement : 2 seconds

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.